SCHEMBL7803673

SCHEMBL7803673

COc1ccc(OCC2COC(c3c(F)cccc3F)=N2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SYK P43405 1/20 0.39
PKM P14618 1/20 0.39
LMNA P02545 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7812409 0.96 MEN1 (0.40) TAAR1ALDH1A1MAPTNPC1RAB9A
SCHEMBL7810550 0.96 MAPT (0.43) TAAR1ALDH1A1MAPTNPC1RAB9A
SCHEMBL7809985 0.93 MAOB (0.42) TAAR1NPC1RAB9ASMN1; SMN2
SCHEMBL8894292 0.89 TAAR1 (0.48) TAAR1
SCHEMBL7812242 0.88 TAAR1 (0.46) TAAR1
SCHEMBL7808814 0.86 TP53 (0.40) TAAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7810324 0.86 TAAR1 (0.39) TAAR1ALDH1A1NPC1RAB9ALMNA
SCHEMBL7812313 0.86 TAAR1 (0.40) TAAR1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL7803372 0.86 TAAR1 (0.43) TAAR1
SCHEMBL7812430 0.84 TAAR1 (0.37) TAAR1SMN1; SMN2MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0553623-B1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL CO (JP) 2001-04-04 EP disclosed
US-5556867-A INSECTICIDES AND MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-09-17 US disclosed
EP-0553623-A1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-04 EP disclosed